Abstract
AutoDock is a suite of C programs used to predict the bound conformations of a small, flexible ligand to a macromolecular target of known structure. The technique combines simulated annealing for conformation searching with a rapid grid-based method of energy evaluation. This paper reviews recent applications of the technique and describes the enhancements included in the current release.
| Original language | American English |
|---|---|
| Pages (from-to) | 1-5 |
| Number of pages | 5 |
| Journal | Journal of Molecular Recognition |
| Volume | 9 |
| Issue number | 1 |
| DOIs | |
| State | Published - 1996 |
| Externally published | Yes |
ASJC Scopus subject areas
- Structural Biology
- Molecular Biology
Keywords
- Automated docking
- Drug design
- Ligand
- Receptor
- Simulated annealing